REMARK  Name = BDB054130
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.365  -0.875   0.238  0.00  0.00    +0.044 C 
ATOM      2  C   LIG    1       -1.246   0.126   0.147  0.00  0.00    -0.036 A 
ATOM      3  C   LIG    1        0.104  -0.249  -0.021  0.00  0.00    +0.068 A 
ATOM      4  C   LIG    1        1.116   0.725  -0.101  0.00  0.00    +0.078 A 
ATOM      5  N   LIG    1        2.477   0.410  -0.268  0.00  0.00    -0.237 NA
ATOM      6  C   LIG    1        2.797  -0.833  -0.349  0.00  0.00    +0.199 A 
ATOM      7  N   LIG    1        1.900  -1.855  -0.284  0.00  0.00    -0.313 N 
ATOM      8  H   LIG    1        2.205  -2.815  -0.354  0.00  0.00    +0.170 HD
ATOM      9  C   LIG    1        0.772   2.075  -0.013  0.00  0.00    +0.028 A 
ATOM     10  C   LIG    1       -0.557   2.461   0.153  0.00  0.00    +0.002 A 
ATOM     11  C   LIG    1        0.551  -1.663  -0.123  0.00  0.00    +0.259 A 
ATOM     12  O   LIG    1       -0.207  -2.624  -0.072  0.00  0.00    -0.267 OA
ATOM     13  C   LIG    1       -1.557   1.493   0.232  0.00  0.00    +0.004 A 
ENDROOT
TORSDOF 0